5-Aminothiazole Hydrochloride - CAS 942631-51-8

Catalog:	BB041256
Product Name:	5-Aminothiazole Hydrochloride
CAS:	942631-51-8
Synonyms:	5-thiazolamine;hydrochloride; 1,3-thiazol-5-amine;hydrochloride

Technical Data

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Computed Properties

IUPAC Name:	1,3-thiazol-5-amine;hydrochloride
Description:	5-Aminothiazole Hydrochloride (CAS# 942631-51-8) is a useful research chemical.
Molecular Weight:	136.60
Molecular Formula:	C3H5ClN2S
Canonical SMILES:	C1=C(SC=N1)N.Cl
InChI:	InChI=1S/C3H4N2S.ClH/c4-3-1-5-2-6-3;/h1-2H,4H2;1H
InChI Key:	WFJPRXNQDKBTPT-UHFFFAOYSA-N
Appearance:	Solid
LogP:	2.10850

Publication Number	Title	Priority Date
CN-107709305-B	Novel compound	20150422
CA-2961833-A1	Herbicidal pyridino-/pyrimidino-thiazoles	20140924
AU-2015229174-A1	Hepatitis B core protein allosteric modulators	20140313
AU-2015229174-B2	Hepatitis B core protein allosteric modulators	20140313
AU-2019203754-A1	Hepatitis B core protein allosteric modulators	20140313

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Related Functional Groups

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	48.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	135.986197
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	135.986197
Rotatable Bond Count:	0
Topological Polar Surface Area:	67.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0